| SpectraBase Spectrum ID |
6w1qdO34NYo |
| Name |
(1S)-1-Phenyl-1-undecanol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
248.214015521 u |
| Formula |
C17H28O |
| InChI |
InChI=1S/C17H28O/c1-2-3-4-5-6-7-8-12-15-17(18)16-13-10-9-11-14-16/h9-11,13-14,17-18H,2-8,12,15H2,1H3/t17-/m0/s1 |
| InChIKey |
CYEZIZHBBKGLCX-KRWDZBQOSA-N |
| Molecular Weight |
248.410 g/mol |
| SMILES |
C=1([C@@](O)(CCCCCCCCCC)[H])C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932128 |
